2-{[5-(5-chloro-2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-nitrophenyl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(5-chloro-2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-nitrophenyl)ethan-1-one
2-{[5-(5-chloro-2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-nitrophenyl)ethan-1-one
Compound characteristics
| Compound ID: | 8430-1448 |
| Compound Name: | 2-{[5-(5-chloro-2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-nitrophenyl)ethan-1-one |
| Molecular Weight: | 405.81 |
| Molecular Formula: | C17 H12 Cl N3 O5 S |
| Smiles: | COc1ccc(cc1c1nnc(o1)SCC(c1ccc(cc1)[N+]([O-])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4796 |
| logD: | 3.4796 |
| logSw: | -4.0239 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.323 |
| InChI Key: | YFCVGGFLRYRADE-UHFFFAOYSA-N |